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750621-52-4

750621-52-4 | N-cycloheptyl-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetamide

CAS No: 750621-52-4 Catalog No: AG01BEBJ MDL No:MFCD03948427

Product Description

Catalog Number:
AG01BEBJ
Chemical Name:
N-cycloheptyl-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetamide
CAS Number:
750621-52-4
Molecular Formula:
C12H21N3OS
Molecular Weight:
255.3796
MDL Number:
MFCD03948427
IUPAC Name:
N-cycloheptyl-2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetamide
InChI:
InChI=1S/C12H21N3OS/c16-11(9-17-12-13-7-8-14-12)15-10-5-3-1-2-4-6-10/h10H,1-9H2,(H,13,14)(H,15,16)
InChI Key:
MINNXTQGIRDHAI-UHFFFAOYSA-N
SMILES:
O=C(NC1CCCCCC1)CSC1=NCCN1

Properties

Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.141g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.38g/mol
Monoisotopic Mass:
255.141g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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